SCHEMBL1849564

SCHEMBL1849564

Cc1nn(C[C@H]2CC[C@H](N)CC2)c(C)c1C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.44
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MERTK Q12866 10/20 0.37
MPO P05164 1/20 0.36
APAF1 O14727 1/20 0.36
AXL P30530 4/20 0.35
TYRO3 Q06418 4/20 0.35
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
BRD4 O60885 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1849563 1.00 CRHR1 (0.44) CRHR1ALDH1A1MAPTMEN1RAB9A
SCHEMBL13696451 0.91 CRHR1 (0.49) CRHR1ALDH1A1MAPTMEN1RAB9A
SCHEMBL18482876 0.82 MEN1 (0.49) CRHR1ALDH1A1MAPTMEN1RAB9A
SCHEMBL26048346 0.79 CRHR1 (0.42) CRHR1ALDH1A1MAPTMEN1RAB9A
SCHEMBL24014820 0.73 MAPT (0.37) CRHR1ALDH1A1MAPTMEN1RAB9A
SCHEMBL15445674 0.70 MAPT (0.35) CRHR1ALDH1A1MAPTMEN1RAB9A
SCHEMBL27877466 0.70 CRHR1 (0.45) CRHR1ALDH1A1MAPTMEN1RAB9A
SCHEMBL15334776 0.69 CRHR1 (0.41) CRHR1ALDH1A1MAPTKMT2ALMNA
SCHEMBL16833300 0.69 MEN1 (0.54) MAPTMEN1RAB9AKMT2ANPSR1
SCHEMBL1849402 0.69 CRHR1 (0.54) CRHR1KMT2AL3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323970-B1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2016-04-20 EP disclosed
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists NOVARTIS AG (CH) 2014-03-27 US disclosed
US-8614213-B2 Cyclohexyl amide derivatives and their use as CRF-1 receptor antagonists NOVARTIS AG (CH) 2013-12-24 US disclosed
US-8273900-B2 Organic compounds NOVARTIS AG (CH) 2012-09-25 US disclosed
CN-102143940-A Cyclohexyl amide derivatives as CRF-1 receptor antagonists and uses thereof NOVARTIS AG 2011-08-03 CN disclosed
US-20110152261-A1 Organic compounds NOVARTIS AG (CH) 2011-06-23 US disclosed
EP-2323970-A1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS Novartis AG (CH) 2011-05-25 EP disclosed
WO-2010015655-A1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2010-02-11 WO disclosed
US-20100035898-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100035898-A1 Organic compounds CRH, CRHR1, CRHR2 CRHR1 2/4885ALDH1A1 2024/4885MAPT 2154/4885
US-20110152261-A1 Organic compounds CRH, CRHR1, CRHR2 CRHR1 2/4885ALDH1A1 2155/4885MAPT 2114/4885
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists CRHR1, CRH, CRHR2 CRHR1 1/4885ALDH1A1 3581/4885MAPT 3612/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.